SCHEMBL16150511

SCHEMBL16150511

Cc1c2n(c3c(C#C[Si](C)(C)C)cc(F)cc13)CCNC2=O

nearest known ligand 0.43

Predicted protein targets (top 2)

geneUniProtsupporting neighboursconfidence
▸ PARP1 P09874 17/20 0.43
▸ PARP2 Q9UGN5 2/20 0.32

Click a target to see other patent compounds predicted against it — the reverse direction, in place.

Similar compounds — the chemically nearest patent molecules

Nearest neighbours by Morgan-fingerprint cosine across the patent-compound collection, with each neighbour's top predicted target and the predicted targets it shares with this molecule.

Compoundsimilaritytop predictedshared targets
SCHEMBL16155884 0.83 PARP1 (0.46) PARP1PARP2
SCHEMBL16151302 0.83 PARP1 (0.47) PARP1PARP2
SCHEMBL16150830 0.79 PARP1 (0.51) PARP1PARP2
SCHEMBL15563682 0.77 PARP1 (0.49) PARP1PARP2
SCHEMBL16151124 0.77 PARP1 (0.49) PARP1PARP2
SCHEMBL17046688 0.75 PARP1 (0.56) PARP1PARP2
SCHEMBL19187621 0.75 PARP1 (0.47) PARP1PARP2
SCHEMBL17439965 0.74 PARP1 (0.44) PARP1
SCHEMBL15563700 0.74 PARP1 (0.55) PARP1
SCHEMBL19187606 0.73 PARP1 (0.46) PARP1PARP2

Similarity is cosine over the 2,048-bit Morgan fingerprint (≈ Tanimoto). Identical fingerprints score 1.00.

Patent provenance — the patents this molecule appears in, and who filed them

Claimed or disclosed in 5 patents. claimed = in the patent's claims; disclosed = body only.

PatentTitleAssigneePublishedPriorityFilingCountryStatus
EP-2981538-B1 PIPERAZINO[1,2-A]INDOL-1-ONES AND [1,4]DIAZEPINO[1,2-A]INDOL-1-ONE HOFFMANN LA ROCHE (CH) 2017-08-02 — — EP disclosed
US-9586966-B2 Piperazino[1,2-a]indol-1-ones and [1,4]diazepino[1,2-a]indol-one HOFFMANN-LA ROCHE INC. (US) 2017-03-07 — — US disclosed
EP-2981538-A1 PIPERAZINO[1,2-A]INDOL-1-ONES AND [1,4]DIAZEPINO[1,2-A]INDOL-1-ONE F. Hoffmann-La Roche AG (CH) 2016-02-10 — — EP disclosed
US-20160016963-A1 Piperazino[1,2-a]indol-1-ones and [1,4]diazepino[1,2-a]indol-one HOFFMANN-LA ROCHE INC. (US) 2016-01-21 — — US disclosed
WO-2014161801-A1 PIPERAZINO[1,2-A]INDOL-1-ONES AND [1,4]DIAZEPINO[1,2-A]INDOL-1-ONE F. HOFFMANN-LA ROCHE AG (CH) 2014-10-09 — — WO disclosed

Patent text — is the patent's own abstract consistent with the prediction?

For each of this compound's patents that has machine-readable text (1 of them — usually the abstract, not the full specification), we ask MedCPT which protein the text reads most about, and where the chemistry-predicted target lands among 4885 human targets. A high rank means the patent's own wording is consistent with the prediction — a weak, independent signal, not proof of activity.

PatentTitleText reads most aboutPredicted target · text-rank
US-20160016963-A1 Piperazino[1,2-a]indol-1-ones and [1,4]diazepino[1,2-a]indol-one DRD3, HTR3C, HTR1D PARP1 205/4885PARP2 529/4885

“Text reads most about” is the patent abstract's nearest protein in MedCPT space (background-debiased). Only ~1.4% of patents have machine-readable text, so most compounds won't have this panel.

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